1-Methyl-5-(Pyridin-3-Yl)-1H-Imidazole-2-Thiol

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Properties Simple | Detailed

Formula C9H9N3S
IUPAC Name 1-methyl-5-(3-pyridyl)imidazole-1,3-diium-2-thione
Molecular Mass 191.253 g·mol−1
Heat of Formation 275.6 ± 16.7 kJ·mol−1
Dipole Moment 5.50 ± 1.08 D
Volume 225.17 Å 3
Surface Area 215.15 Å 2
HOMO Energy -8.04 ± 0.55 eV
LUMO Energy -0.95 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-dihydro-1-methyl-5-(3-pyridinyl)-2h-imidazole-2-thione
  • 1-methyl-2-mercapto-5-(3-pyridyl)imidazole
  • 1-methyl-5-(3-pyridyl)-3h-imidazole-2-thione
  • 1-methyl-5-pyridin-3-yl-3h-imidazole-2-thione
  • kc 6141
  • kc-6141
CAS Number(s)
  • 51941-16-3
InChIKey DEUPXTPWWLUQRX-UHFFFAOYSA-N
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